SCHEMBL8126003

SCHEMBL8126003

O=S(=O)(Nc1ncco1)c1ccc(-c2ncco2)cc1

nearest known ligand 0.44

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ SCN9A Q15858 15/20 0.44
▸ GPR119 Q8TDV5 1/20 0.43
▸ EDNRB P24530 1/20 0.43
▸ EDNRA P25101 1/20 0.43
▸ HSD11B1 P28845 2/20 0.43
▸ LTA4H P09960 1/20 0.42

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL28919283 0.81 LMNA (0.57) EDNRBEDNRA
SCHEMBL6026448 0.81 HSD11B1 (0.56) SCN9AHSD11B1
SCHEMBL8110606 0.80 HSD11B1 (0.48) SCN9AHSD11B1
SCHEMBL8111406 0.79 ALDH1A1 (0.60) SCN9AEDNRA
SCHEMBL8125378 0.79 LMNA (0.44) SCN9AGPR119EDNRBEDNRA
SCHEMBL5228000 0.79 GPR119 (0.54) GPR119
SCHEMBL5228220 0.77 PTPN2 (0.58) —
SCHEMBL1951129 0.77 LTA4H (0.49) GPR119EDNRBEDNRALTA4H
SCHEMBL8108924 0.77 FBP1 (0.71) —
SCHEMBL5228131 0.76 PSEN1 (0.52) GPR119

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1036069-A1 BENZENESULFONAMIDE COMPOUNDS PHARMACIA & UPJOHN S.p.A. (IT) 2000-09-20 — — EP claimed
WO-1999028306-A1 BENZENESULFONAMIDE COMPOUNDS PHARMACIA & UPJOHN S.P.A. (IT) 1999-06-10 — — WO claimed
EP-1036069-A1 BENZENESULFONAMIDE COMPOUNDS PHARMACIA & UPJOHN S.p.A. (IT) 2000-09-20 — — EP disclosed
WO-1999028306-A1 BENZENESULFONAMIDE COMPOUNDS PHARMACIA & UPJOHN S.P.A. (IT) 1999-06-10 — — WO disclosed
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